Related entries (identical compound): BML81210 PR100939 PR100938 ML003951 JP004081 BML01674 FIO00077 FIO00079 PR100474 ML003901 BML01684 FIO00082 FIO00083 FIO00080 FIO00081 FIO00084 BML81213 BML01652 FIO00078 BML01641 BML81211 BML81212

Submission id: BML01684

Outputs for Esculetin; LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-

Database: Institute of Biological Chemistry, Washington State University
Entry ID: BML01684
Synonyms: Esculetin
Total mass: 178.1413
Formula: H6 C9 O4

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: Agilent 1200 RRLC; Agilent 6520 QTOF
Instrument type: LC-ESI-QTOF
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 104.0259, 105.0654, 106.1528, 107.0142, 133.0666, 133.0891, 149.3111,
Processing time: 0:00:01.193403
Queried mass list: ['102.089', '105.035', '109.031', '121.031', '133.030', '149.023', '173.905', '177.021']

Queried mass	Num. matched formulas	Num. matched fragments
102.0886 (link to fragments)	1	6
105.0349 (link to fragments)	1	6
109.0308 (link to fragments)	2	8
121.0315 (link to fragments)	2	6
133.0298 (link to fragments)	2	5
149.0234 (link to fragments)	2	8
173.9047 (link to fragments)	1	1
177.0206 (link to fragments)	1	1